Detailed information for compound 69307

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 668.886 | Formula: C36H52N4O6S
  • H donors: 4 H acceptors: 6 LogP: 4.61 Rotable bonds: 18
    Rule of 5 violations (Lipinski): 2
  • SMILES: CC(C[C@@H]([C@@H]([C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1[C@@H]([C@H]1C(=O)N1CCOCC1)Cc1ccccc1)Cc1ncsc1)CC1CCCCC1)O)O)C
  • InChi: 1S/C36H52N4O6S/c1-23(2)17-30(41)33(42)28(19-25-11-7-4-8-12-25)38-34(43)29(20-26-21-47-22-37-26)39-35(44)31-27(18-24-9-5-3-6-10-24)32(31)36(45)40-13-15-46-16-14-40/h3,5-6,9-10,21-23,25,27-33,41-42H,4,7-8,11-20H2,1-2H3,(H,38,43)(H,39,44)/t27-,28-,29-,30-,31+,32+,33+/m0/s1
  • InChiKey: DDPPBKSFIPPHAN-OSJIZEKLSA-N  

Network

Hover on a compound node to display the structore

Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens renin Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Echinococcus multilocularis cathepsin d (lysosomal aspartyl protease) Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium yoelii hypothetical protein Get druggable targets OG5_126885 All targets in OG5_126885
Theileria parva pepsinogen, putative Get druggable targets OG5_126885 All targets in OG5_126885
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) Get druggable targets OG5_126885 All targets in OG5_126885
Candida albicans vacuolar aspartic proteinase precursor similar to S. cerevisiae PEP4 (YPL154C) Get druggable targets OG5_126885 All targets in OG5_126885
Schistosoma japonicum Cathepsin D precursor, putative Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium falciparum plasmepsin I Get druggable targets OG5_126885 All targets in OG5_126885
Theileria parva cathepsin E, putative Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium vivax plasmepsin IV, putative Get druggable targets OG5_126885 All targets in OG5_126885
Schistosoma mansoni cathepsin D (A01 family) Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium knowlesi plasmepsin IV, putative Get druggable targets OG5_126885 All targets in OG5_126885
Cryptosporidium parvum membrane bound aspartyl proteinase with a signal peptide plus transmembrane domain Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium falciparum plasmepsin VI Get druggable targets OG5_126885 All targets in OG5_126885
Schistosoma mansoni cathepsin D (A01 family) Get druggable targets OG5_126885 All targets in OG5_126885
Schistosoma japonicum ko:K01379 cathepsin D [EC3.4.23.5], putative Get druggable targets OG5_126885 All targets in OG5_126885
Trichomonas vaginalis Clan AA, family A1, cathepsin D-like aspartic peptidase Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium berghei plasmepsin IV Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium berghei plasmepsin VI Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium yoelii plasmepsin Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium falciparum plasmepsin II Get druggable targets OG5_126885 All targets in OG5_126885
Toxoplasma gondii aspartyl proteinase (eimepsin), putative Get druggable targets OG5_126885 All targets in OG5_126885
Loa Loa (eye worm) aspartic protease BmAsp-2 Get druggable targets OG5_126885 All targets in OG5_126885
Neospora caninum Pepsinogen A1, related Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium vivax aspartyl proteinase, putative Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium falciparum plasmepsin IV Get druggable targets OG5_126885 All targets in OG5_126885
Neospora caninum Renin, related Get druggable targets OG5_126885 All targets in OG5_126885
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_126885 All targets in OG5_126885
Babesia bovis eukaryotic aspartyl protease family protein Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium knowlesi aspartyl protease, putative Get druggable targets OG5_126885 All targets in OG5_126885
Cryptosporidium hominis aspartyl protease precursor Get druggable targets OG5_126885 All targets in OG5_126885
Echinococcus granulosus cathepsin d lysosomal aspartyl protease Get druggable targets OG5_126885 All targets in OG5_126885
Toxoplasma gondii aspartyl protease ASP1 Get druggable targets OG5_126885 All targets in OG5_126885
Candida albicans vacuolar aspartic proteinase precursor similar to S. cerevisiae PEP4 (YPL154C) Get druggable targets OG5_126885 All targets in OG5_126885
Plasmodium yoelii hypothetical protein Get druggable targets OG5_126885 All targets in OG5_126885

By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Plasmodium falciparum plasmepsin X renin 406 aa 352 aa 26.4 %

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0646 1 1
Schistosoma mansoni cathepsin D (A01 family) 0.0174 0.2533 0.2533
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0646 1 1
Entamoeba histolytica cysteine protease, putative 0.0333 0.5044 0.4054
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0119 0.1665 0.1025
Brugia malayi Papain family cysteine protease containing protein 0.0119 0.1665 0.1665
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0119 0.1665 0.1025
Onchocerca volvulus Cathepsin L homolog 0.0119 0.1665 0.1665
Plasmodium falciparum dipeptidyl aminopeptidase 2 0.0119 0.1665 0.1665
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0333 0.5044 0.4664
Entamoeba histolytica cysteine protease, putative 0.0333 0.5044 0.4054
Plasmodium falciparum serine repeat antigen 7 0.0119 0.1665 0.1665
Loa Loa (eye worm) CAMK/PIM protein kinase 0.0623 0.9649 0.9649
Leishmania major cathepsin L-like protease 0.0646 1 1
Loa Loa (eye worm) hypothetical protein 0.0432 0.6621 0.6621
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0646 1 1
Loa Loa (eye worm) hypothetical protein 0.0213 0.3158 0.3158
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0119 0.1665 0.1665
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0646 1 1
Echinococcus granulosus cathepsin L 0.0333 0.5044 0.4664
Schistosoma mansoni carbonic anhydrase-related 0.0209 0.3095 0.3095
Onchocerca volvulus Serine\/threonine protein kinase homolog 0.0623 0.9649 0.9649
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0646 1 1
Leishmania major carbonic anhydrase-like protein 0.0412 0.6304 0.5565
Schistosoma mansoni serine/threonine protein kinase 0.0623 0.9649 0.9649
Schistosoma mansoni cathepsin s 0.0213 0.3158 0.3158
Brugia malayi cathepsin Z-like cysteine proteinase 0.0119 0.1665 0.1665
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0646 1 1
Loa Loa (eye worm) aspartic protease BmAsp-2 0.0059 0.0713 0.0713
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0432 0.6621 0.6362
Plasmodium falciparum plasmepsin VI 0.0059 0.0713 0.0713
Plasmodium vivax dipeptidyl aminopeptidase 1, putative 0.0119 0.1665 0.1665
Brugia malayi Cathepsin L-like precursor 0.0646 1 1
Loa Loa (eye worm) cysteine protease 0.0646 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0646 1 1
Loa Loa (eye worm) hypothetical protein 0.0059 0.0713 0.0713
Onchocerca volvulus 0.0646 1 1
Trypanosoma cruzi cysteine protease, putative 0.0333 0.5044 0.4054
Giardia lamblia Cathepsin B-like cysteine proteinase 3 precursor 0.0119 0.1665 0.5
Plasmodium falciparum serine repeat antigen 3 0.0119 0.1665 0.1665
Giardia lamblia Cathepsin B precursor 0.0119 0.1665 0.5
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0119 0.1665 0.1025
Loa Loa (eye worm) hypothetical protein 0.0119 0.1665 0.1665
Loa Loa (eye worm) fibroinase 0.0646 1 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0646 1 1
Plasmodium vivax serine-repeat antigen 2 (SERA) 0.0119 0.1665 0.1665
Trypanosoma cruzi cruzipain precursor, putative 0.0213 0.3158 0.1791
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0646 1 1
Trypanosoma cruzi cysteine peptidase, putative 0.0213 0.3158 0.1791
Brugia malayi Cathepsin L-like precursor 0.0432 0.6621 0.6621
Brugia malayi fibroinase precursor 0.0119 0.1665 0.1665
Brugia malayi Protein kinase domain containing protein 0.0623 0.9649 0.9649
Echinococcus granulosus cathepsin l cysteine peptidase 0.0646 1 1
Entamoeba histolytica cysteine protease, putative 0.0333 0.5044 0.4054
Giardia lamblia Cathepsin B precursor 0.0119 0.1665 0.5
Echinococcus multilocularis carbonic anhydrase 0.0209 0.3095 0.2565
Plasmodium vivax dipeptidyl aminopeptidase 2, putative 0.0119 0.1665 0.1665
Entamoeba histolytica cysteine protease, putative 0.0333 0.5044 0.4054
Giardia lamblia Cathepsin L precursor 0.0119 0.1665 0.5
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.0209 0.3095 0.3095
Plasmodium vivax serine-repeat antigen 5 (SERA) 0.0119 0.1665 0.1665
Loa Loa (eye worm) cysteine proteinase cathepsin Z 0.0119 0.1665 0.1665
Entamoeba histolytica cysteine proteinase, putative 0.0432 0.6621 0.5946
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.0412 0.6304 0.6304
Trypanosoma cruzi cysteine peptidase (N-terminal), putative 0.0333 0.5044 0.4054
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0646 1 1
Giardia lamblia Cathepsin B precursor 0.0119 0.1665 0.5
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0119 0.1665 0.1665
Entamoeba histolytica cysteine proteinase, putative 0.0333 0.5044 0.4054
Plasmodium falciparum plasmepsin IV 0.0059 0.0713 0.0713
Plasmodium falciparum serine repeat antigen 5 0.0119 0.1665 0.1665
Brugia malayi cathepsin L precursor 0.0119 0.1665 0.1665
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0646 1 1
Plasmodium falciparum serine repeat antigen 2 0.0119 0.1665 0.1665
Schistosoma mansoni subfamily C1A unassigned peptidase (C01 family) 0.0119 0.1665 0.1665
Brugia malayi cahepsin L-like non-peptiedase homolog 0.0119 0.1665 0.1665
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0119 0.1665 0.1025
Onchocerca volvulus 0.0646 1 1
Schistosoma mansoni hypothetical protein 0.0209 0.3095 0.3095
Trypanosoma cruzi cysteine peptidase, putative 0.0646 1 1
Brugia malayi cathepsin L-like precursor 0.0432 0.6621 0.6621
Plasmodium vivax vivapain-3 0.0333 0.5044 0.5044
Loa Loa (eye worm) carbonic anhydrase 3 0.0412 0.6304 0.6304
Schistosoma mansoni carbonic anhydrase-related 0.0209 0.3095 0.3095
Echinococcus granulosus carbonic anhydrase 0.0209 0.3095 0.2565
Schistosoma mansoni carbonic anhydrase II (carbonate dehydratase II) 0.0412 0.6304 0.6304
Brugia malayi Papain family cysteine protease containing protein 0.0333 0.5044 0.5044
Giardia lamblia Cysteine protease 0.0119 0.1665 0.5
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0333 0.5044 0.5044
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0646 1 1
Echinococcus granulosus cathepsin l1 0.0432 0.6621 0.6362
Trypanosoma cruzi cysteine peptidase, putative 0.0333 0.5044 0.4054
Echinococcus multilocularis cathepsin L cysteine protease 0.0646 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0646 1 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0119 0.1665 0.1665
Plasmodium vivax unspecified product 0.0119 0.1665 0.1665
Entamoeba histolytica cysteine proteinase, putative 0.0646 1 1
Loa Loa (eye worm) hypothetical protein 0.0213 0.3158 0.3158
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.0412 0.6304 0.5565
Onchocerca volvulus 0.0646 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0646 1 1
Entamoeba histolytica cysteine proteinase, putative 0.0333 0.5044 0.4054
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0646 1 1
Leishmania major cathepsin L-like protease 0.0646 1 1
Onchocerca volvulus 0.0119 0.1665 0.1665
Toxoplasma gondii aspartyl protease ASP1 0.0059 0.0713 0.0713
Echinococcus multilocularis cathepsin b 0.0119 0.1665 0.1025
Plasmodium falciparum carbonic anhydrase 0.0209 0.3095 0.3095
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0646 1 1
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0333 0.5044 0.5044
Loa Loa (eye worm) cathepsin B 0.0119 0.1665 0.1665
Echinococcus granulosus proto oncogene serine:threonine protein kinase 0.0623 0.9649 0.9622
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0119 0.1665 0.1025
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0119 0.1665 0.1025
Brugia malayi Cathepsin L-like precursor 0.0432 0.6621 0.6621
Entamoeba histolytica cysteine proteinase 2 0.0333 0.5044 0.4054
Brugia malayi Cathepsin L-like cysteine proteinase 0.0432 0.6621 0.6621
Plasmodium falciparum plasmepsin I 0.0059 0.0713 0.0713
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0646 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0646 1 1
Giardia lamblia Cathepsin B precursor 0.0119 0.1665 0.5
Echinococcus granulosus carbonic anhydrase II 0.0412 0.6304 0.602
Loa Loa (eye worm) ctsf protein 0.0646 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0646 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0646 1 1
Giardia lamblia Cathepsin L precursor 0.0119 0.1665 0.5
Schistosoma mansoni cathepsin F (C01 family) 0.0432 0.6621 0.6621
Brugia malayi Putative carbonic anhydrase 5 precursor 0.0412 0.6304 0.6304
Giardia lamblia Dipeptidyl-peptidase I precursor 0.0119 0.1665 0.5
Plasmodium vivax serine-repeat antigen 3 (SERA) 0.0119 0.1665 0.1665
Brugia malayi cathepsin L-like cysteine proteinase 0.0119 0.1665 0.1665
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0119 0.1665 0.1025
Plasmodium vivax serine-repeat antigen (SERA) 0.0119 0.1665 0.1665
Loa Loa (eye worm) hypothetical protein 0.0209 0.3095 0.3095
Entamoeba histolytica cysteine proteinase, putative 0.0333 0.5044 0.4054
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0646 1 1
Trichomonas vaginalis conserved hypothetical protein 0.0119 0.1665 0.1025
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.0412 0.6304 0.6304
Giardia lamblia Cathepsin L precursor 0.0119 0.1665 0.5
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0646 1 1
Echinococcus granulosus cysteine protease 0.0333 0.5044 0.4664
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0646 1 1
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0209 0.3095 0.3095
Echinococcus granulosus carbonic anhydrase 0.0209 0.3095 0.2565
Entamoeba histolytica cysteine protease, putative 0.0333 0.5044 0.4054
Loa Loa (eye worm) hypothetical protein 0.0119 0.1665 0.1665
Plasmodium vivax vivapain-2 0.0646 1 1
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0646 1 1
Plasmodium vivax serine-repeat antigen 4 (SERA), putative 0.0119 0.1665 0.1665
Plasmodium vivax unspecified product 0.0333 0.5044 0.5044
Echinococcus multilocularis carbonic anhydrase 0.0209 0.3095 0.2565
Entamoeba histolytica cysteine protease, putative 0.0333 0.5044 0.4054
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0646 1 1
Entamoeba histolytica cysteine proteinase 1, putative 0.0333 0.5044 0.4054
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0209 0.3095 0.3095
Echinococcus granulosus cathepsin L cysteine proteinase 0.0646 1 1
Entamoeba histolytica cysteine protease, putative 0.0333 0.5044 0.4054
Plasmodium falciparum plasmepsin II 0.0059 0.0713 0.0713
Onchocerca volvulus Cathepsin F homolog 0.0646 1 1
Giardia lamblia Dipeptidyl-peptidase I precursor 0.0119 0.1665 0.5
Giardia lamblia Cysteine protease 0.0119 0.1665 0.5
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0432 0.6621 0.6362
Schistosoma mansoni cathepsin D (A01 family) 0.0174 0.2533 0.2533
Loa Loa (eye worm) hypothetical protein 0.0209 0.3095 0.3095
Entamoeba histolytica cysteine protease, putative 0.0333 0.5044 0.4054
Brugia malayi Papain family cysteine protease containing protein 0.0646 1 1
Toxoplasma gondii cathepsin B 0.0119 0.1665 0.1665
Entamoeba histolytica cysteine protease, putative 0.0646 1 1
Schistosoma mansoni subfamily A1A unassigned peptidase (A01 family) 0.0059 0.0713 0.0713
Loa Loa (eye worm) hypothetical protein 0.0213 0.3158 0.3158
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0119 0.1665 0.1025
Echinococcus multilocularis cysteine protease 0.0646 1 1
Loa Loa (eye worm) hypothetical protein 0.0119 0.1665 0.1665
Giardia lamblia Cathepsin B precursor 0.0119 0.1665 0.5
Onchocerca volvulus 0.0432 0.6621 0.6621
Giardia lamblia Cathepsin L precursor 0.0119 0.1665 0.5
Brugia malayi Cathepsin L-like precursor 0.0646 1 1
Plasmodium vivax vivapain-1 0.0333 0.5044 0.5044
Trichomonas vaginalis Clan CA, family C1, cathepsin F-like cysteine peptidase 0.0119 0.1665 0.1025
Brugia malayi cathepsin L-like cysteine proteinase, identical 0.0213 0.3158 0.3158
Plasmodium vivax serine-repeat antigen 4 (SERA) 0.0119 0.1665 0.1665
Schistosoma mansoni carbonic anhydrase 0.0209 0.3095 0.3095
Echinococcus multilocularis cathepsin L cysteine protease 0.0646 1 1
Plasmodium vivax serine-repeat antigen (SERA) 0.0119 0.1665 0.1665
Leishmania major cathepsin L-like protease 0.0646 1 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0333 0.5044 0.4054
Trichomonas vaginalis Clan CA, family C1, cathepsin L or H-like cysteine peptidase 0.0119 0.1665 0.1025
Toxoplasma gondii aspartyl proteinase (eimepsin), putative 0.0059 0.0713 0.0713
Entamoeba histolytica cysteine protease, putative 0.0333 0.5044 0.4054
Loa Loa (eye worm) hypothetical protein 0.0119 0.1665 0.1665
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0119 0.1665 0.1025
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0646 1 1
Brugia malayi Papain family cysteine protease containing protein 0.0119 0.1665 0.1665
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0412 0.6304 0.6304
Plasmodium vivax dipeptidyl aminopeptidase 3, putative 0.0119 0.1665 0.1665
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0119 0.1665 0.1025
Trypanosoma cruzi cysteine peptidase, putative 0.0646 1 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0119 0.1665 0.1665
Giardia lamblia Cathepsin L-like protease 0.0119 0.1665 0.5
Loa Loa (eye worm) hypothetical protein 0.0119 0.1665 0.1665
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0333 0.5044 0.4664
Brugia malayi cathepsin F-like cysteine proteinase 0.0119 0.1665 0.1665
Giardia lamblia Cathepsin L precursor 0.0119 0.1665 0.5
Entamoeba histolytica cysteine protease, putative 0.0333 0.5044 0.4054
Echinococcus granulosus carbonic anhydrase 0.0209 0.3095 0.2565
Brugia malayi Cathepsin L-like precursor 0.0646 1 1
Plasmodium vivax plasmepsin IV, putative 0.0059 0.0713 0.0713
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0119 0.1665 0.1665
Schistosoma mansoni subfamily C1A unassigned peptidase (C01 family) 0.0119 0.1665 0.1665
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0646 1 1
Leishmania major cathepsin L-like protease 0.0646 1 1
Plasmodium falciparum cysteine proteinase falcipain 1 0.0333 0.5044 0.5044
Echinococcus multilocularis cathepsin b 0.0119 0.1665 0.1025
Brugia malayi Eukaryotic-type carbonic anhydrase family protein 0.0209 0.3095 0.3095
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0646 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0646 1 1
Trypanosoma cruzi carbonic anhydrase-like protein, putative 0.0412 0.6304 0.5565
Plasmodium falciparum serine repeat antigen 9 0.0119 0.1665 0.1665
Echinococcus multilocularis carbonic anhydrase II 0.0412 0.6304 0.602
Loa Loa (eye worm) hypothetical protein 0.0119 0.1665 0.1665
Brugia malayi cathepsin Z-like cysteine proteinase 0.0119 0.1665 0.1665
Plasmodium falciparum serine repeat antigen 6 0.0119 0.1665 0.1665
Echinococcus granulosus cathepsin L 0.0119 0.1665 0.1025
Plasmodium falciparum serine repeat antigen 8 0.0119 0.1665 0.1665
Loa Loa (eye worm) eukaryotic-type carbonic anhydrase 0.0209 0.3095 0.3095
Giardia lamblia Cathepsin B precursor 0.0119 0.1665 0.5
Loa Loa (eye worm) hypothetical protein 0.0119 0.1665 0.1665
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0119 0.1665 0.1025
Echinococcus multilocularis cysteine protease 0.0646 1 1
Schistosoma mansoni cathepsin F (C01 family) 0.0646 1 1
Plasmodium falciparum dipeptidyl aminopeptidase 3 0.0119 0.1665 0.1665
Leishmania major cathepsin L-like protease 0.0646 1 1
Trypanosoma cruzi cysteine proteinase, putative 0.0333 0.5044 0.4054
Trypanosoma cruzi cysteine proteinase, putative 0.0333 0.5044 0.4054
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0646 1 1
Schistosoma mansoni subfamily C1A non-peptidase homologue (C01 family) 0.0119 0.1665 0.1665
Onchocerca volvulus 0.0646 1 1
Trypanosoma cruzi cysteine peptidase, putative 0.0646 1 1
Echinococcus multilocularis carbonic anhydrase 0.0209 0.3095 0.2565
Leishmania major cathepsin L-like protease 0.0646 1 1
Entamoeba histolytica cysteine proteinase, putative 0.0333 0.5044 0.4054
Plasmodium vivax aspartyl proteinase, putative 0.0059 0.0713 0.0713
Toxoplasma gondii cathepsin CPC1 0.0119 0.1665 0.1665
Schistosoma mansoni carbonic anhydrase-related 0.0209 0.3095 0.3095
Giardia lamblia Dipeptidyl-peptidase I precursor 0.0119 0.1665 0.5
Echinococcus granulosus cathepsin b 0.0119 0.1665 0.1025
Schistosoma mansoni dipeptidyl-peptidase I (C01 family) 0.0119 0.1665 0.1665
Giardia lamblia Cathepsin B precursor 0.0119 0.1665 0.5
Echinococcus granulosus cathepsin l1 0.0646 1 1
Onchocerca volvulus Cathepsin L homolog 0.0646 1 1
Echinococcus multilocularis proto oncogene serine:threonine protein kinase 0.0623 0.9649 0.9622
Brugia malayi Cathepsin L-like precursor 0.0646 1 1
Onchocerca volvulus 0.0646 1 1
Trypanosoma cruzi cruzipain precursor, putative 0.0646 1 1
Schistosoma mansoni cathepsin F (C01 family) 0.0646 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin H-like cysteine peptidase 0.0119 0.1665 0.1025
Loa Loa (eye worm) hypothetical protein 0.0646 1 1
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0213 0.3158 0.3158
Giardia lamblia Cysteine protease 0.0119 0.1665 0.5
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0119 0.1665 0.1665
Brugia malayi cathepsin B-like cysteine proteinase 0.0119 0.1665 0.1665
Echinococcus granulosus cathepsin b 0.0119 0.1665 0.1025
Plasmodium vivax unspecified product 0.0213 0.3158 0.3158
Plasmodium vivax serine-repeat antigen (SERA), putative 0.0119 0.1665 0.1665
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0646 1 1
Loa Loa (eye worm) hypothetical protein 0.0432 0.6621 0.6621
Onchocerca volvulus 0.0646 1 1
Giardia lamblia Cysteine protease 0.0119 0.1665 0.5
Entamoeba histolytica cysteine proteinase, putative 0.0646 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.0119 0.1665 0.1025
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0646 1 1
Leishmania major cathepsin L-like protease 0.0646 1 1
Plasmodium falciparum serine repeat antigen 4 0.0119 0.1665 0.1665
Schistosoma mansoni cathepsin B (C01 family) 0.0119 0.1665 0.1665
Giardia lamblia Hypothetical protein 0.0119 0.1665 0.5
Toxoplasma gondii preprocathepsin c precursor, putative 0.0119 0.1665 0.1665
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0119 0.1665 0.1665
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0333 0.5044 0.4054
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0646 1 1
Giardia lamblia Cathepsin L precursor 0.0119 0.1665 0.5
Plasmodium falciparum dipeptidyl aminopeptidase 1 0.0119 0.1665 0.1665
Brugia malayi Papain family cysteine protease containing protein 0.0333 0.5044 0.5044
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0119 0.1665 0.1665
Brugia malayi Cathepsin L-like precursor 0.0646 1 1
Giardia lamblia Cathepsin L-like protease 0.0119 0.1665 0.5
Trypanosoma brucei carbonic anhydrase-like protein 0.0412 0.6304 0.5565
Trichomonas vaginalis conserved hypothetical protein 0.0119 0.1665 0.1025
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0333 0.5044 0.5044
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0646 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0119 0.1665 0.1025
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0646 1 1
Giardia lamblia Hypothetical protein 0.0119 0.1665 0.5
Loa Loa (eye worm) hypothetical protein 0.0432 0.6621 0.6621
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0119 0.1665 0.1665
Brugia malayi Carbonic anhydrase like protein 2 precursor 0.0209 0.3095 0.3095
Brugia malayi Serine/threonine-protein kinase Pim-3 0.0623 0.9649 0.9649
Brugia malayi cathepsin F-like cysteine proteinase 0.0213 0.3158 0.3158
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0646 1 1
Plasmodium falciparum serine repeat antigen 1 0.0119 0.1665 0.1665
Echinococcus granulosus cathepsin L cysteine protease 0.0333 0.5044 0.4664
Leishmania major cysteine peptidase A (CPA) 0.0646 1 1
Schistosoma mansoni cathepsin C 0.0119 0.1665 0.1665
Plasmodium vivax serine-repeat antigen (SERA), putative 0.0119 0.1665 0.1665
Onchocerca volvulus Cathepsin L homolog 0.0646 1 1
Entamoeba histolytica cysteine protease, putative 0.0333 0.5044 0.4054
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0646 1 1
Toxoplasma gondii cathepsin CPL 0.0646 1 1
Trypanosoma cruzi cysteine peptidase, putative 0.0646 1 1
Plasmodium falciparum cysteine proteinase falcipain 3 0.0646 1 1
Toxoplasma gondii cathepsin CPC2 0.0119 0.1665 0.1665
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0432 0.6621 0.5946
Entamoeba histolytica cysteine protease, putative 0.0333 0.5044 0.4054
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0119 0.1665 0.1025
Trichomonas vaginalis Clan CA, family C1, cathepsin L, S or H-like cysteine peptidase 0.0119 0.1665 0.1025
Schistosoma mansoni cathepsin S (C01 family) 0.0119 0.1665 0.1665
Giardia lamblia Cathepsin B precursor 0.0119 0.1665 0.5
Loa Loa (eye worm) hypothetical protein 0.0209 0.3095 0.3095
Onchocerca volvulus 0.0646 1 1
Plasmodium vivax vivapain-2 0.0646 1 1
Brugia malayi Cathepsin L-like precursor 0.0213 0.3158 0.3158
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0646 1 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0646 1 1
Leishmania major cathepsin L-like protease 0.0646 1 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0646 1 1
Giardia lamblia Encystation-specific protease 0.0119 0.1665 0.5
Toxoplasma gondii hypothetical protein 0.0209 0.3095 0.3095
Entamoeba histolytica cysteine protease, putative 0.0333 0.5044 0.4054
Brugia malayi Papain family cysteine protease containing protein 0.0119 0.1665 0.1665
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0119 0.1665 0.1665
Schistosoma mansoni SmCB2 peptidase (C01 family) 0.0119 0.1665 0.1665
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0646 1 1
Echinococcus multilocularis cathepsin L 0.0333 0.5044 0.4664
Loa Loa (eye worm) CAMK/PIM protein kinase 0.0623 0.9649 0.9649
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0119 0.1665 0.1665
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0646 1 1
Echinococcus multilocularis cathepsin L 0.0119 0.1665 0.1025

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 120 nM In vitro inhibition of purified human renin at a pH of 6.0. ChEMBL. 1588553
IC50 (binding) = 120 nM In vitro inhibition of purified human renin at a pH of 6.0. ChEMBL. 1588553

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
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External resources for this compound

No external resources registered for this compound

Bibliographic References

1 literature reference was collected for this gene.

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